Information card for entry 1507005

Structure parameters

• Common name: 03113b
• Formula: C18 H24 I N O3
• Calculated formula: C18 H24 I N O3
• Title of publication: Amino acid-derived iodobenzene dicarboxylates: reagents for oxidative conversion of alkenes to amino acid esters.
• Authors of publication: Koposov, Alexey Y.; Boyarskikh, Vyacheslav V.; Zhdankin, Viktor V.
• Journal of publication: Organic letters
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 20
• Pages of publication: 3613 - 3615
• a: 9.6884 ± 0.0011 Å
• b: 17.902 ± 0.002 Å
• c: 11.163 ± 0.0013 Å
• α: 90°
• β: 93.511 ± 0.002°
• γ: 90°
• Cell volume: 1932.5 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0648
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.1418
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No